| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 20th, 2011 | 18 | Yes |
Popular Name: (2S)-2-(5-chloro-2-thienyl)-2-(4-ethyl-4-methyl-1-piperidyl)ethanamine (2S)-2-(5-chloro-2-thienyl)-2-(4…
| Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
|---|---|---|---|---|---|---|---|---|---|---|
| Ref Reference (pH 7) | 3.33 | 5.13 | -46.77 | 3 | 2 | 1 | 31 | 287.88 | 4 | ↓ |
| Hi High (pH 8-9.5) | 3.33 | 4.96 | -2.15 | 2 | 2 | 0 | 29 | 286.872 | 4 | ↓ |
| Mid Mid (pH 6-8) | 3.33 | 6.99 | -34.28 | 3 | 2 | 1 | 30 | 287.88 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 3.33 | 7.33 | -123.96 | 4 | 2 | 2 | 32 | 288.888 | 4 | ↓ |
